N-(4-acetylphenyl)-1-(2-chlorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-1-(2-chlorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
N-(4-acetylphenyl)-1-(2-chlorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
Compound ID: | D351-2360 |
Compound Name: | N-(4-acetylphenyl)-1-(2-chlorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide |
Molecular Weight: | 416.87 |
Molecular Formula: | C23 H17 Cl N4 O2 |
Smiles: | CC(c1ccc(cc1)NC(c1nc(c2ccccc2)n(c2ccccc2[Cl])n1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6964 |
logD: | 4.6962 |
logSw: | -4.8382 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.506 |
InChI Key: | RBHUZIQSBXDSTC-UHFFFAOYSA-N |